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Author Topic: Use ATK pseudopotentials in SIESTA  (Read 2980 times)

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Offline exenGT

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Use ATK pseudopotentials in SIESTA
« on: October 21, 2017, 23:59 »
Dear All,

I'm interested in testing ATK pseudopotentials in SIESTA. Is there a way to find the pseudopotentials? And are they compatible with SIESTA?

Thanks!
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Offline Petr Khomyakov

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Re: Use ATK pseudopotentials in SIESTA
« Reply #1 on: October 23, 2017, 09:39 »
We do not provide pseudopotentials for the use in other codes. However, these pseudopotentials are standard ones, so you may download them from the web, e.g., http://www.quantum-simulation.org/potentials/sg15_oncv/. Which pseudopotentials are compatible with SIESTA, it is a question to SIESTA developers. Please consult their website.
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